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CAS 376591-97-8
Also known as: 376591-97-8, 3'-amino-2'-hydroxybiphenyl-3-carboxylic acid hydrochloride, 3'-amino-2'-hydroxybiphenyl-3-carboxylic acid hcl, 3-(3-amino-2-hydroxyphenyl)benzoic acid;hydrochloride, 3'-amino-2'-hydroxy-[1,1'-biphenyl]-3-carboxylic acid hcl, Schembl4861328
Molecular Formula
C13H12ClNO3
Molecular Weight
265.69  g/mol
InChI Key
HHPDYYCDILLKCD-UHFFFAOYSA-N

1 2D Structure

CAS 376591-97-8

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
3-(3-amino-2-hydroxyphenyl)benzoic acid;hydrochloride
2.1.2 InChI
InChI=1S/C13H11NO3.ClH/c14-11-6-2-5-10(12(11)15)8-3-1-4-9(7-8)13(16)17;/h1-7,15H,14H2,(H,16,17);1H
2.1.3 InChI Key
HHPDYYCDILLKCD-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1=CC(=CC(=C1)C(=O)O)C2=C(C(=CC=C2)N)O.Cl
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 376591-97-8

2. 3'-amino-2'-hydroxybiphenyl-3-carboxylic Acid Hydrochloride

3. 3'-amino-2'-hydroxybiphenyl-3-carboxylic Acid Hcl

4. 3-(3-amino-2-hydroxyphenyl)benzoic Acid;hydrochloride

5. 3'-amino-2'-hydroxy-[1,1'-biphenyl]-3-carboxylic Acid Hcl

6. Schembl4861328

7. Dtxsid50740025

8. Amy22071

9. Mfcd22376588

10. [1,1'-biphenyl]-3-carboxylic Acid, 3'-amino-2'-hydroxy-, Hydrochloride

11. Akos022173373

12. Ac-30855

13. F11722

14. 3'-amino-2'-hydroxy-[1,1'-biphenyl]-3-carboxylicacidhydrochloride

15. 3-amino-2-hydroxy-[1,1-biphenyl]-3-carboxylic Acid Hcl

16. 3'-amino-2'-hydroxy[1,1'-biphenyl]-3-carboxylic Acid--hydrogen Chloride (1/1)

2.3 Create Date
2012-11-30
3 Chemical and Physical Properties
Molecular Weight 265.69 g/mol
Molecular Formula C13H12ClNO3
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass265.0505709 g/mol
Monoisotopic Mass265.0505709 g/mol
Topological Polar Surface Area83.6 Ų
Heavy Atom Count18
Formal Charge0
Complexity282
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count2
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Shenzhen HwaGen Pharmaceutical Co., Ltd. (HwaGen Pharma) was founded in December of 2015 under the leader...
Shenzhen HwaGen Pharmaceutical Co., Ltd. (HwaGen Pharma) was founded in December of 2015 under the leadership of a “National 1000 Talents Program” expert. By leveraging its core competency in chiral synthesis, enzymatic catalysis and continuous flow micro reactor, HwaGen Pharmaceutical is dedicated to development and manufacturing of specialty and niche intermediates and APIs covering various therapeutic areas including oncology, antiviral and respiratory, delivering high value-added and affordable products for global pharmaceutical industry. Equipments for Analysis & Test include Tabletop NMR, LC-MS, GC, HPLC etc.
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Shenzhen HwaGen Pharmaceutical Co., Ltd. (HwaGen Pharma) was founded in December of 2015 under the leader...
Shenzhen HwaGen Pharmaceutical Co., Ltd. (HwaGen Pharma) was founded in December of 2015 under the leadership of a “National 1000 Talents Program” expert. By leveraging its core competency in chiral synthesis, enzymatic catalysis and continuous flow micro reactor, HwaGen Pharmaceutical is dedicated to development and manufacturing of specialty and niche intermediates and APIs covering various therapeutic areas including oncology, antiviral and respiratory, delivering high value-added and affordable products for global pharmaceutical industry. Equipments for Analysis & Test include Tabletop NMR, LC-MS, GC, HPLC etc.
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Shenzhen HwaGen Pharmaceutical Co., Ltd. (HwaGen Pharma) was founded in December of 2015 under the leader...
Shenzhen HwaGen Pharmaceutical Co., Ltd. (HwaGen Pharma) was founded in December of 2015 under the leadership of a “National 1000 Talents Program” expert. By leveraging its core competency in chiral synthesis, enzymatic catalysis and continuous flow micro reactor, HwaGen Pharmaceutical is dedicated to development and manufacturing of specialty and niche intermediates and APIs covering various therapeutic areas including oncology, antiviral and respiratory, delivering high value-added and affordable products for global pharmaceutical industry. Equipments for Analysis & Test include Tabletop NMR, LC-MS, GC, HPLC etc.
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Shenzhen HwaGen Pharmaceutical Co., Ltd. (HwaGen Pharma) was founded in December of 2015 under the leader...
Shenzhen HwaGen Pharmaceutical Co., Ltd. (HwaGen Pharma) was founded in December of 2015 under the leadership of a “National 1000 Talents Program” expert. By leveraging its core competency in chiral synthesis, enzymatic catalysis and continuous flow micro reactor, HwaGen Pharmaceutical is dedicated to development and manufacturing of specialty and niche intermediates and APIs covering various therapeutic areas including oncology, antiviral and respiratory, delivering high value-added and affordable products for global pharmaceutical industry. Equipments for Analysis & Test include Tabletop NMR, LC-MS, GC, HPLC etc.
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